1-cyclopropyl-7-[4-(dimethylaminomethyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-7-[4-(dimethylaminomethyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-[4-(dimethylaminomethyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-[4-(dimethylaminomethyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-[4-(dimethylaminomethyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-7-[4-(dimethylaminomethyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C25H28N2O4S MolecularWeight: 452.56582

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1CCCC2=C1C=C(S2)C3=C(C4=C(C=C3)C(=O)C(=CN4C5CC5)C(=O)O)OC

Isomeric SMILES

CN(C)CC1CCCC2=C1C=C(S2)C3=C(C4=C(C=C3)C(=O)C(=CN4C5CC5)C(=O)O)OC

InChI

InChI=1S/C25H28N2O4S/c1-26(2)12-14-5-4-6-20-18(14)11-21(32-20)16-9-10-17-22(24(16)31-3)27(15-7-8-15)13-19(23(17)28)25(29)30/h9-11,13-15H,4-8,12H2,1-3H3,(H,29,30)